4.8 Article

Melting versus Decomposition of GaN: Ab Initio Molecular Dynamics Study and Comparison to Experimental Data

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Nitrogen Dissolution in Liquid Ga and Fe: Comprehensive Ab Initio Analysis, Relevance for Crystallization of GaN

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Summary: The study investigated the dissolution of molecular nitrogen in liquid gallium and iron through ab initio calculations and experiments, revealing fundamental differences in N bonding between the two solvents. It was found that the nitrogen solubility in iron is much higher than in gallium, indicating that liquid iron may be a prospective solvent for gallium nitride crystallization from metallic solutions.

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